1-isothiocyanato-3,5-dimethoxybenzene
Chemical Structure Depiction of
1-isothiocyanato-3,5-dimethoxybenzene
1-isothiocyanato-3,5-dimethoxybenzene
Compound characteristics
| Compound ID: | 8018-1723 |
| Compound Name: | 1-isothiocyanato-3,5-dimethoxybenzene |
| Molecular Weight: | 195.24 |
| Molecular Formula: | C9 H9 N O2 S |
| Smiles: | COc1cc(cc(c1)OC)N=C=S |
| Stereo: | ACHIRAL |
| logP: | 3.7382 |
| logD: | 3.7382 |
| logSw: | -4.0533 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 24.0362 |
| InChI Key: | FKUHOOASBHTEQY-UHFFFAOYSA-N |